Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 6/20 | 0.60 |
| ▸ | AVPR1A | P37288 | 6/20 | 0.60 |
| ▸ | HSD17B3 | P37058 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | OXTR | P30559 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8560249 | 0.87 | HPGD (0.53) | AVPR2AVPR1AHSD17B3HPGDALDH1A1 | |
| SCHEMBL8558451 | 0.86 | HSD17B3 (0.53) | AVPR2AVPR1AHSD17B3 | |
| SCHEMBL8558342 | 0.85 | HPGD (0.48) | AVPR2AVPR1AHSD17B3HPGDALDH1A1 | |
| SCHEMBL7341183 | 0.82 | AVPR2 (0.57) | AVPR2AVPR1AHSD17B3HPGDALDH1A1 | |
| SCHEMBL8555952 | 0.82 | NAMPT (0.51) | AVPR2AVPR1AHSD17B3HPGDALDH1A1 | |
| SCHEMBL8556540 | 0.81 | HSD17B3 (0.45) | AVPR2AVPR1AHSD17B3HPGDRAB9A | |
| SCHEMBL8557987 | 0.79 | AVPR2 (0.53) | AVPR2AVPR1AHSD17B3HPGDALDH1A1 | |
| SCHEMBL8561766 | 0.79 | HSD17B3 (0.50) | AVPR2AVPR1AHSD17B3SMN1; SMN2 | |
| SCHEMBL8560873 | 0.79 | ACHE (0.60) | AVPR2AVPR1AHSD17B3RAB9ANAMPT | |
| SCHEMBL8562598 | 0.79 | PDE4A (0.54) | AVPR2AVPR1AHSD17B3ALDH1A1RAB9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0640592-B1 | N-acylated tricyclic azaheterorings useful as vasopressin antagonists | AMERICAN CYANAMID CO (US) | 1998-12-30 | — | — | EP | disclosed |
| WO-1997047624-A1 | TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS | AMERICAN CYANAMID COMPANY (US) | 1997-12-18 | — | — | WO | disclosed |
| EP-0640592-A1 | N-acylated tricyclic azaheterorings useful as vasopressin antagonists | AMERICAN CYANAMID COMPANY (US) | 1995-03-01 | — | — | EP | disclosed |